7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride

C8H13ClF3N — CID 172880664

IUPAC7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride
SMILESCl.FC(F)(F)C1CCNC2(CC2)C1
InChIInChI=1S/C8H12F3N.ClH/c9-8(10,11)6-1-4-12-7(5-6)2-3-7;/h6,12H,1-5H2;1H
InChIKeyFSBZJGFYRSHYAZ-UHFFFAOYSA-N
MW215.65 g/mol
LogP2.50
Rot. Bonds

About 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride

7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride (PubChem CID 172880664) has the molecular formula C8H13ClF3N and a molecular weight of 215.65 g/mol. Its IUPAC name is 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride.

Molecular Properties

Compound Name7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride
PubChem CID172880664
Molecular FormulaC8H13ClF3N
Molecular Weight215.65 g/mol
Exact Mass215.07
IUPAC Name7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride
SMILESCl.FC(F)(F)C1CCNC2(CC2)C1
InChIInChI=1S/C8H12F3N.ClH/c9-8(10,11)6-1-4-12-7(5-6)2-3-7;/h6,12H,1-5H2;1H
InChIKeyFSBZJGFYRSHYAZ-UHFFFAOYSA-N
XLogP2.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.65
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(8R)-8-tert-butyl-5-azaspiro[3.5]nonane
CID 171594365
6-(trifluoromethyl)-4-azaspiro[2.5]octane
CID 136575476
(7R)-7-methyl-4-azaspiro[2.5]octane
CID 155722557
4-fluoro-1-azaspiro[5.5]undecane;hydrochloride
CID 115025639
(8R)-5-azaspiro[3.5]nonan-8-ol
CID 96637049
15-methoxy-3,11-bis(trifluoromethyl)-7-azadispiro[5.1.58.36]hexadecane
CID 165129271
7-(trifluoromethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79507320
8-methyl-5-azaspiro[3.5]nonane
CID 89432250
8-iodo-5-azaspiro[3.5]nonane
CID 170139848
(6S)-4-azaspiro[2.4]heptan-6-ol;hydrochloride
CID 162342438
ethane;(8S)-8-methyl-5-azaspiro[3.5]nonane
CID 169125658
N-(5-azaspiro[3.5]nonan-8-yl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103310321

Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride?
The IUPAC name of 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride (CID 172880664) is 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride.
What is the SMILES notation for 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride?
The canonical SMILES for 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride is Cl.FC(F)(F)C1CCNC2(CC2)C1.
What is the InChIKey of 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride?
The InChIKey is FSBZJGFYRSHYAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3N.ClH/c9-8(10,11)6-1-4-12-7(5-6)2-3-7;/h6,12H,1-5H2;1H.
What are the key properties of 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride?
7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride has a molecular weight of 215.65 g/mol, XLogP of 2.50, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)-4-azaspiro[2.5]octane;hydrochloride is sourced from PubChem (CID 172880664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).